Input 01-casida.02-vib_modes.inp

Commits > Commit f22bb0bcca4b53614d336c5e83de089ff68b1baa > Run foss-mpi-min: [foss2022a-mpi]

Matches

Name Value Reference Precision Difference Status
Bond stretch 2.254370315750000e+03 2.254370315750000e+03 1.130000000000000e-07 0.000000000000000e+00 PASS
Libration 1 3.214013080700000e+02 3.214104111100000e+02 1.680000000000000e-02 -9.103040000013607e-03 PASS
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